EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

isobutyl undecylenate
isobutyl 10-undecenoate

Supplier Sponsors

Name:2-methylpropyl undec-10-enoate
CAS Number: 5421-27-2Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:226-538-8
FDA UNII: 6G584PZ24X
Nikkaji Web:J218.000F
XlogP3:5.50 (est)
Molecular Weight:240.38656000
Formula:C15 H28 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
JECFA Food Flavoring:1634 isobutyl 10-undecenoate
FEMA Number:4358 isobutyl 10-undecenoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):5421-27-2 ; ISOBUTYL 10-UNDECENOATE
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.86800 to 0.87300 @ 20.00 °C.
Pounds per Gallon - (est).: 7.231 to 7.273
Refractive Index:1.43800 to 1.44200 @ 20.00 °C.
Boiling Point: 264.00 to 266.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.001000 mmHg @ 25.00 °C. (est)
Flash Point: 258.00 °F. TCC ( 125.56 °C. )
logP (o/w): 5.825 (est)
Soluble in:
 alcohol
 water, 0.1798 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
allyl undecylenate
amyl undecylenate
isoamyl undecylenate
butyl undecylenate
para-cresyl 10-undecylenate
ethyl undecylenate
geranyl undecylenate
heptyl undecylenate
methyl undecylenate
isopropyl undecylenate
 
Organoleptic Properties:
Odor Type: fatty
fatty fruity waxy
Odor Description:at 100.00 %. fatty fruity waxy
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
isoButyl Undec-10-enoate
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
 
Safety Information:
European information :
Most important hazard(s):
None - None found.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
flavor and fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for isobutyl undecylenate usage levels up to:
  8.0000 % in the fragrance concentrate.
 
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 23
Click here to view publication 23
 average usual ppmaverage maximum ppm
baked goods: 20.0000046.00000
beverages(nonalcoholic): 0.500003.00000
beverages(alcoholic): 2.0000010.00000
breakfast cereal: --
cheese: --
chewing gum: 0.10000-
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: 2.000003.00000
granulated sugar: --
gravies: --
hard candy: 7.0000020.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: 5.00000-
soups: --
sugar substitutes: --
sweet sauces: 3.00000-
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):5421-27-2
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :79457
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2-methylpropyl undec-10-enoate
Chemidplus:0005421272
 
References:
 2-methylpropyl undec-10-enoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):79457
Pubchem (sid):135039000
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Substances Added to Food (formerly EAFUS):View
HMDB (The Human Metabolome Database):HMDB32347
FooDB:FDB009643
ChemSpider:View
 
Potential Blenders and core components note
For Odor
No odor group found for these
iso
valeraldehyde diethyl acetal
FL/FR
aldehydic
aldehydic
iso
valeraldehyde
FL/FR
buttery
acetyl butyryl
FL/FR
coconut
delta-
undecalactone
FL/FR
creamy
gamma-
butyrolactone
FL/FR
dairy
methyl butyl phenyl acetate
FL/FR
ethereal
decyl propionate
FL/FR
fatty
allyl cyclohexyl hexanoate
FL/FR
allyl decanoate
FL/FR
allyl octanoate
FL/FR
coconut absolute
FL/FR
(S)-gamma-
decalactone
FL/FR
(R)-gamma-
decalactone
FL/FR
dodecyl butyrate
FL/FR
ethyl undecylenate
FL/FR
(Z)-3-
octen-1-ol
FL/FR
floral
citronellyl propionate
FL/FR
gelsone (IFF)
FL/FR
(E)-
geranyl acetone
FL/FR
geranyl hexanoate
FL/FR
jasmin absolute egypt (from concrete)
FL/FR
methyl citronellate
FL/FR
octyl acetate
FL/FR
fruity
allyl 10-undecenoate
FL/FR
allyl cyclohexyl butyrate
FL/FR
allyl heptanoate
FL/FR
iso
amyl isobutyrate
FL/FR
iso
amyl octanoate
FL/FR
decyl butyrate
FL/FR
(S)-gamma-
dodecalactone
FL/FR
ethyl 5-hydroxyoctanoate
FL/FR
ethyl hexanoate
FL/FR
(E)-2-
hepten-1-yl acetate
FL/FR
3-
hexanone
FL/FR
methyl (E,Z)-2,4-decadienoate
FL/FR
methyl 3-nonenoate
FL/FR
(E)-2-
nonen-1-yl acetate
FL/FR
octyl butyrate
FL/FR
octyl heptanoate
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
2-
undecanone
FL/FR
green
ethyl (E)-2-decenoate
FL/FR
ethyl (E)-4-decenoate
FL/FR
3-
heptanone
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
hexyl 2-methyl butyrate
FL/FR
hexyl phenyl acetate
FL/FR
herbal
benzyl octanoate
FL/FR
butyl levulinate
FL/FR
musk
iso
ambrettolide
FL/FR
oily
petal pyranone
FL/FR
sulfurous
O-
methyl S-1-methoxyhexan-3-yl carbonothioate
FL/FR
vegetable
1-
furfuryl pyrrole
FL/FR
waxy
allyl nonanoate
FL/FR
3-
decanone
FL/FR
(Z)-4-
decen-1-ol
FL/FR
9-
decenoic acid
FL/FR
dihydrocitronellyl acetate
FL/FR
ethyl decanoate
FL/FR
ethyl palmitate
FL/FR
heptyl octanoate
FL/FR
methyl undecanoate
FR
(E)-2-
octen-1-yl butyrate
FL/FR
octyl 2-methyl butyrate
FL/FR
propyl decanoate
FL/FR
(E)-2-
tridecen-1-yl acetate
FL/FR
winey
2-
hexanol
FL/FR
For Flavor
No flavor group found for these
allyl 10-undecenoate
FL/FR
allyl cyclohexyl butyrate
FL/FR
allyl cyclohexyl hexanoate
FL/FR
benzyl octanoate
FL/FR
cocos nucifera water
FL
(S)-gamma-
decalactone
FL/FR
(R)-gamma-
decalactone
FL/FR
3-
decanone
FL/FR
(Z)-4-
decen-1-ol
FL/FR
decyl propionate
FL/FR
dihydrocitronellyl acetate
FL/FR
(S)-gamma-
dodecalactone
FL/FR
dodecyl butyrate
FL/FR
2,3-
epoxyoctanal
FL
ethyl 5-hydroxyoctanoate
FL/FR
(E)-2-
hepten-1-yl acetate
FL/FR
2-
hexanol
FL/FR
methyl (E,Z)-2,4-decadienoate
FL/FR
4-
methyl pentyl 4-methyl valerate
FL
3-
methyl-2-cyclopenten-1-one
FL
4-
methyl-2-pentenoic acid
FL
3,5-
octadien-2-one
FL
(E)-2-
octen-1-yl butyrate
FL/FR
octyl heptanoate
FL/FR
oenanthic ether
FL
propyl decanoate
FL/FR
(E)-2-
tridecen-1-yl acetate
FL/FR
iso
valeraldehyde diethyl acetal
FL/FR
valeraldehyde diethyl acetal
FL
acidic
acidic
(E)-2-
hexenoic acid
FL
coconut
(R)-
massoia lactone
FL
creamy
acetyl butyryl
FL/FR
delta-
undecalactone
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
dairy
methyl butyl phenyl acetate
FL/FR
fatty
allyl octanoate
FL/FR
coconut absolute
FL/FR
ethyl (E)-4-decenoate
FL/FR
ethyl undecylenate
FL/FR
(Z)-3-
octen-1-ol
FL/FR
2-
pentyl thiophene
FL
2,4-
undecadienal
FL
floral
citronellyl propionate
FL/FR
(E)-
geranyl acetone
FL/FR
jasmin absolute egypt (from concrete)
FL/FR
methyl citronellate
FL/FR
fruity
allyl decanoate
FL/FR
allyl heptanoate
FL/FR
iso
amyl isobutyrate
FL/FR
iso
amyl octanoate
FL/FR
decyl butyrate
FL/FR
ethyl (E)-2-decenoate
FL/FR
ethyl hexanoate
FL/FR
geranyl hexanoate
FL/FR
3-
hexanone
FL/FR
hexyl phenyl acetate
FL/FR
methyl (E)-3-nonenoate
FL
methyl 3-nonenoate
FL/FR
iso
valeraldehyde
FL/FR
green
gelsone (IFF)
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
(E)-3-
hexenoic acid
FL
hexyl 2-methyl butyrate
FL/FR
methyl 2-undecynoate
FL
3-(5-
methyl-2-furyl) butanal
FL
herbal
butyl levulinate
FL/FR
ketonic
3-
heptanone
FL/FR
milky
gamma-
butyrolactone
FL/FR
musk
iso
ambrettolide
FL/FR
oily
petal pyranone
FL/FR
roasted
O-
methyl S-1-methoxyhexan-3-yl carbonothioate
FL/FR
vegetable
1-
furfuryl pyrrole
FL/FR
waxy
allyl nonanoate
FL/FR
9-
decenoic acid
FL/FR
ethyl decanoate
FL/FR
ethyl palmitate
FL/FR
heptyl octanoate
FL/FR
(E)-2-
nonen-1-yl acetate
FL/FR
octyl 2-methyl butyrate
FL/FR
octyl acetate
FL/FR
octyl butyrate
FL/FR
2-
undecanone
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
isobutyl 10-undecenoate
isobutyl undec-10-enoate
2-methylpropyl undec-10-enoate
10-undecenoic acid 2-methyl propyl ester
10-undecenoic acid 2-methylpropyl ester
10-undecenoic acid, 2-methylpropyl ester
10-undecenoic acid,2-methylpropyl ester
 
 
Notes:
Used as a food additive [EAFUS]
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